REMARK  Name = BDB009374
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.192  -0.121   0.920  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1       -0.091  -0.585   2.201  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1        0.706  -0.286   3.236  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1       -1.215  -1.372   2.431  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1       -2.079  -1.675   1.376  0.00  0.00    +0.007 A 
ATOM      6  C   LIG    1       -1.837  -1.176   0.086  0.00  0.00    -0.041 A 
ATOM      7  C   LIG    1       -0.686  -0.404  -0.135  0.00  0.00    +0.020 A 
ENDROOT
BRANCH   1  12
ATOM      8  N   LIG    1        5.425  -0.519   1.284  0.00  0.00    -0.178 NA
ATOM      9  C   LIG    1        4.998   0.861   1.614  0.00  0.00    +0.128 C 
ATOM     10  C   LIG    1        3.740   1.257   0.832  0.00  0.00    +0.125 C 
ATOM     11  N   LIG    1        2.632   0.315   1.006  0.00  0.00    -0.295 N 
ATOM     12  C   LIG    1        1.358   0.741   0.653  0.00  0.00    +0.249 C 
ATOM     13  O   LIG    1        1.148   1.813   0.086  0.00  0.00    -0.270 OA
ATOM     14  C   LIG    1        2.991  -1.047   1.427  0.00  0.00    +0.125 C 
ATOM     15  C   LIG    1        4.367  -1.480   0.897  0.00  0.00    +0.128 C 
BRANCH   8  16
ATOM     16  S   LIG    1        7.025  -0.843   0.933  0.00  0.00    +0.032 S 
ATOM     17  O   LIG    1        7.165  -2.271   0.749  0.00  0.00    -0.158 OA
ATOM     18  O   LIG    1        7.824  -0.136   1.912  0.00  0.00    -0.158 OA
BRANCH  16  20
ATOM     19  C   LIG    1        6.453  -0.564  -1.776  0.00  0.00    +0.029 C 
ATOM     20  C   LIG    1        7.308  -0.041  -0.644  0.00  0.00    +0.182 C 
ENDBRANCH  16  20
ENDBRANCH   8  16
ENDBRANCH   1  12
BRANCH   6  21
ATOM     21  C   LIG    1       -2.773  -1.489  -1.061  0.00  0.00    +0.092 C 
BRANCH  21  22
ATOM     22  C   LIG    1       -4.237  -1.184  -0.756  0.00  0.00    +0.069 A 
ATOM     23  C   LIG    1       -4.759   0.206  -0.945  0.00  0.00    -0.016 A 
ATOM     24  C   LIG    1       -3.856   1.317  -1.401  0.00  0.00    +0.037 C 
ATOM     25  C   LIG    1       -4.475   2.710  -1.248  0.00  0.00    +0.005 C 
ATOM     26  C   LIG    1       -5.932   2.719  -1.690  0.00  0.00    +0.005 C 
ATOM     27  C   LIG    1       -6.757   1.723  -0.873  0.00  0.00    +0.041 C 
ATOM     28  C   LIG    1       -6.065   0.400  -0.690  0.00  0.00    +0.023 A 
ATOM     29  C   LIG    1       -6.906  -0.725  -0.211  0.00  0.00    +0.268 A 
ATOM     30  O   LIG    1       -8.096  -0.580   0.049  0.00  0.00    -0.266 OA
ATOM     31  N   LIG    1       -6.272  -1.930  -0.074  0.00  0.00    -0.243 N 
ATOM     32  H   LIG    1       -6.832  -2.713   0.247  0.00  0.00    +0.192 HD
ATOM     33  N   LIG    1       -4.964  -2.181  -0.343  0.00  0.00    -0.175 NA
ENDBRANCH  21  22
ENDBRANCH   6  21
TORSDOF 5